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3-Benzoyl-2-t-butyl-4-(1-hydroxy-3-methyl-butyl)-oxazolidin-5-one
SpectraBase Compound ID JFMf9j69Wef
InChI InChI=1S/C19H27NO4/c1-12(2)11-14(21)15-17(23)24-18(19(3,4)5)20(15)16(22)13-9-7-6-8-10-13/h6-10,12,14-15,18,21H,11H2,1-5H3
InChIKey LJGQORUVMJOQSQ-UHFFFAOYSA-N
Mol Weight 333.43 g/mol
Molecular Formula C19H27NO4
Exact Mass 333.194008 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3d9IK47r8I3
Name 3-Benzoyl-2-T-butyl-4-(1-hydroxy-3-methyl-butyl)-oxazolidin-5-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.194008349 u
Formula C19H27NO4
InChI InChI=1S/C19H27NO4/c1-12(2)11-14(21)15-17(23)24-18(19(3,4)5)20(15)16(22)13-9-7-6-8-10-13/h6-10,12,14-15,18,21H,11H2,1-5H3
InChIKey LJGQORUVMJOQSQ-UHFFFAOYSA-N
Molecular Weight 333.428 g/mol
SMILES C1=CC(C(=O)N2C(C(C)(C)C)OC(C2C(O)CC(C)C)=O)=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.864776